USER MOD reduce.3.24.130724 H: found=0, std=0, add=274, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 274 hydrogens (11 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 DT C7 :methyl -30:sc= -2.22 (180deg=-2.03) USER MOD Set 1.2: A 7 DT C7 :methyl -30:sc= -0.301 (180deg=-0.661) USER MOD Single : A 1 DT C7 :methyl 150:sc= -0.153 (180deg=-0.153) USER MOD Single : A 1 DT O5' : rot 103:sc= 0 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.619 (180deg=-1.03) USER MOD Single : A 12 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 13 DT C7 :methyl 150:sc= -0.02 (180deg=-0.02) USER MOD Single : A 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl -30:sc= -0.07 (180deg=-0.552) USER MOD Single : A 24 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 3.704 -7.278 -8.166 1.00 0.00 O ATOM 2 C5' DT A 1 4.032 -7.414 -6.783 1.00 0.00 C ATOM 3 C4' DT A 1 2.811 -7.418 -5.842 1.00 0.00 C ATOM 4 O4' DT A 1 2.183 -6.136 -5.789 1.00 0.00 O ATOM 5 C3' DT A 1 1.739 -8.458 -6.245 1.00 0.00 C ATOM 6 O3' DT A 1 1.497 -9.355 -5.160 1.00 0.00 O ATOM 7 C2' DT A 1 0.563 -7.546 -6.597 1.00 0.00 C ATOM 8 C1' DT A 1 0.790 -6.369 -5.664 1.00 0.00 C ATOM 9 N1 DT A 1 -0.057 -5.212 -6.063 1.00 0.00 N ATOM 10 C2 DT A 1 -1.284 -5.039 -5.409 1.00 0.00 C ATOM 11 O2 DT A 1 -1.641 -5.713 -4.446 1.00 0.00 O ATOM 12 N3 DT A 1 -2.127 -4.068 -5.907 1.00 0.00 N ATOM 13 C4 DT A 1 -1.869 -3.269 -6.997 1.00 0.00 C ATOM 14 O4 DT A 1 -2.704 -2.429 -7.326 1.00 0.00 O ATOM 15 C5 DT A 1 -0.578 -3.502 -7.640 1.00 0.00 C ATOM 16 C7 DT A 1 -0.170 -2.671 -8.840 1.00 0.00 C ATOM 17 C6 DT A 1 0.278 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-2.648 -4.822 -0.686 1.00 0.00 H new ATOM 0 H21 DG A 3 -2.449 -7.395 1.591 1.00 0.00 H new ATOM 0 H22 DG A 3 -3.417 -6.113 0.854 1.00 0.00 H new ATOM 96 P DG A 4 4.684 -10.061 2.987 1.00 0.00 P ATOM 97 OP1 DG A 4 5.859 -10.973 3.060 1.00 0.00 O ATOM 98 OP2 DG A 4 3.760 -10.008 4.152 1.00 0.00 O ATOM 99 O5' DG A 4 5.224 -8.565 2.688 1.00 0.00 O ATOM 100 C5' DG A 4 6.081 -8.298 1.580 1.00 0.00 C ATOM 101 C4' DG A 4 6.255 -6.798 1.304 1.00 0.00 C ATOM 102 O4' DG A 4 5.018 -6.201 0.917 1.00 0.00 O ATOM 103 C3' DG A 4 6.835 -6.036 2.510 1.00 0.00 C ATOM 104 O3' DG A 4 8.066 -5.418 2.128 1.00 0.00 O ATOM 105 C2' DG A 4 5.698 -5.075 2.872 1.00 0.00 C ATOM 106 C1' DG A 4 4.882 -4.957 1.582 1.00 0.00 C ATOM 107 N9 DG A 4 3.439 -4.677 1.795 1.00 0.00 N ATOM 108 C8 DG A 4 2.565 -5.268 2.679 1.00 0.00 C ATOM 109 N7 DG A 4 1.335 -4.826 2.613 1.00 0.00 N ATOM 110 C5 DG A 4 1.400 -3.865 1.598 1.00 0.00 C ATOM 111 C6 DG A 4 0.379 -3.036 1.020 1.00 0.00 C ATOM 112 O6 DG A 4 -0.813 -2.986 1.300 1.00 0.00 O ATOM 113 N1 DG A 4 0.824 -2.231 0.000 1.00 0.00 N ATOM 114 C2 DG A 4 2.109 -2.202 -0.416 1.00 0.00 C ATOM 115 N2 DG A 4 2.407 -1.380 -1.383 1.00 0.00 N ATOM 116 N3 DG A 4 3.095 -2.936 0.095 1.00 0.00 N ATOM 117 C4 DG A 4 2.679 -3.764 1.098 1.00 0.00 C ATOM 0 H5' DG A 4 5.677 -8.781 0.690 1.00 0.00 H new ATOM 0 H5'' DG A 4 7.058 -8.743 1.768 1.00 0.00 H new ATOM 0 H4' DG A 4 6.970 -6.722 0.485 1.00 0.00 H new ATOM 0 H3' DG A 4 7.109 -6.637 3.377 1.00 0.00 H new ATOM 0 H2' DG A 4 5.094 -5.464 3.692 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.082 -4.106 3.191 1.00 0.00 H new ATOM 0 H1' DG A 4 5.261 -4.110 1.011 1.00 0.00 H new ATOM 0 H8 DG A 4 2.871 -6.037 3.373 1.00 0.00 H new ATOM 0 H1 DG A 4 0.150 -1.624 -0.467 1.00 0.00 H new ATOM 0 H21 DG A 4 3.365 -1.325 -1.729 1.00 0.00 H new ATOM 0 H22 DG A 4 1.682 -0.792 -1.794 1.00 0.00 H new ATOM 129 P DG A 5 9.074 -4.674 3.164 1.00 0.00 P ATOM 130 OP1 DG A 5 10.418 -5.306 3.032 1.00 0.00 O ATOM 131 OP2 DG A 5 8.453 -4.622 4.516 1.00 0.00 O ATOM 132 O5' DG A 5 9.162 -3.155 2.603 1.00 0.00 O ATOM 133 C5' DG A 5 9.885 -2.848 1.409 1.00 0.00 C ATOM 134 C4' DG A 5 9.590 -1.452 0.821 1.00 0.00 C ATOM 135 O4' DG A 5 8.195 -1.361 0.528 1.00 0.00 O ATOM 136 C3' DG A 5 9.932 -0.295 1.783 1.00 0.00 C ATOM 137 O3' DG A 5 10.297 0.917 1.125 1.00 0.00 O ATOM 138 C2' DG A 5 8.596 -0.040 2.464 1.00 0.00 C ATOM 139 C1' DG A 5 7.637 -0.309 1.300 1.00 0.00 C ATOM 140 N9 DG A 5 6.259 -0.611 1.749 1.00 0.00 N ATOM 141 C8 DG A 5 5.847 -1.365 2.821 1.00 0.00 C ATOM 142 N7 DG A 5 4.559 -1.350 3.039 1.00 0.00 N ATOM 143 C5 DG A 5 4.084 -0.476 2.053 1.00 0.00 C ATOM 144 C6 DG A 5 2.759 0.014 1.786 1.00 0.00 C ATOM 145 O6 DG A 5 1.707 -0.285 2.350 1.00 0.00 O ATOM 146 N1 DG A 5 2.708 0.938 0.764 1.00 0.00 N ATOM 147 C2 DG A 5 3.797 1.352 0.074 1.00 0.00 C ATOM 148 N2 DG A 5 3.639 2.297 -0.813 1.00 0.00 N ATOM 149 N3 DG A 5 5.035 0.893 0.246 1.00 0.00 N ATOM 150 C4 DG A 5 5.117 -0.017 1.264 1.00 0.00 C ATOM 0 H5' DG A 5 9.654 -3.601 0.656 1.00 0.00 H new ATOM 0 H5'' DG A 5 10.952 -2.922 1.617 1.00 0.00 H new ATOM 0 H4' DG A 5 10.216 -1.351 -0.066 1.00 0.00 H new ATOM 0 H3' DG A 5 10.776 -0.562 2.420 1.00 0.00 H new ATOM 0 H2' DG A 5 8.425 -0.710 3.306 1.00 0.00 H new ATOM 0 H2'' DG A 5 8.512 0.978 2.845 1.00 0.00 H new ATOM 0 H1' DG A 5 7.534 0.591 0.693 1.00 0.00 H new ATOM 0 H8 DG A 5 6.535 -1.927 3.436 1.00 0.00 H new ATOM 0 H1 DG A 5 1.801 1.331 0.514 1.00 0.00 H new ATOM 0 H21 DG A 5 4.439 2.632 -1.350 1.00 0.00 H new ATOM 0 H22 DG A 5 2.715 2.701 -0.969 1.00 0.00 H new ATOM 162 P DT A 6 11.809 1.288 0.692 1.00 0.00 P ATOM 163 OP1 DT A 6 12.724 0.899 1.801 1.00 0.00 O ATOM 164 OP2 DT A 6 11.807 2.706 0.244 1.00 0.00 O ATOM 165 O5' DT A 6 12.109 0.369 -0.610 1.00 0.00 O ATOM 166 C5' DT A 6 13.178 -0.571 -0.656 1.00 0.00 C ATOM 167 C4' DT A 6 13.237 -1.383 -1.967 1.00 0.00 C ATOM 168 O4' DT A 6 12.526 -2.606 -1.844 1.00 0.00 O ATOM 169 C3' DT A 6 12.701 -0.656 -3.221 1.00 0.00 C ATOM 170 O3' DT A 6 13.656 -0.757 -4.278 1.00 0.00 O ATOM 171 C2' DT A 6 11.402 -1.443 -3.470 1.00 0.00 C ATOM 172 C1' DT A 6 11.865 -2.843 -3.075 1.00 0.00 C ATOM 173 N1 DT A 6 10.865 -3.922 -2.849 1.00 0.00 N ATOM 174 C2 DT A 6 11.381 -5.228 -2.791 1.00 0.00 C ATOM 175 O2 DT A 6 12.499 -5.552 -3.197 1.00 0.00 O ATOM 176 N3 DT A 6 10.580 -6.195 -2.232 1.00 0.00 N ATOM 177 C4 DT A 6 9.323 -5.992 -1.713 1.00 0.00 C ATOM 178 O4 DT A 6 8.743 -6.951 -1.206 1.00 0.00 O ATOM 179 C5 DT A 6 8.814 -4.627 -1.860 1.00 0.00 C ATOM 180 C7 DT A 6 7.446 -4.256 -1.330 1.00 0.00 C ATOM 181 C6 DT A 6 9.570 -3.657 -2.440 1.00 0.00 C ATOM 0 H5' DT A 6 13.080 -1.260 0.183 1.00 0.00 H new ATOM 0 H5'' DT A 6 14.121 -0.041 -0.525 1.00 0.00 H new ATOM 0 H4' DT A 6 14.304 -1.546 -2.117 1.00 0.00 H new ATOM 0 H3' DT A 6 12.526 0.416 -3.129 1.00 0.00 H new ATOM 0 H2' DT A 6 10.575 -1.088 -2.855 1.00 0.00 H new ATOM 0 H2'' DT A 6 11.074 -1.389 -4.508 1.00 0.00 H new ATOM 0 H1' DT A 6 12.429 -3.241 -3.919 1.00 0.00 H new ATOM 0 H3 DT A 6 10.950 -7.145 -2.199 1.00 0.00 H new ATOM 0 H71 DT A 6 6.793 -5.128 -1.367 1.00 0.00 H new ATOM 0 H72 DT A 6 7.536 -3.913 -0.299 1.00 0.00 H new ATOM 0 H73 DT A 6 7.023 -3.459 -1.942 1.00 0.00 H new ATOM 0 H6 DT A 6 9.156 -2.670 -2.583 1.00 0.00 H new ATOM 194 P DT A 7 13.432 -0.060 -5.721 1.00 0.00 P ATOM 195 OP1 DT A 7 14.764 0.063 -6.378 1.00 0.00 O ATOM 196 OP2 DT A 7 12.616 1.172 -5.544 1.00 0.00 O ATOM 197 O5' DT A 7 12.550 -1.151 -6.526 1.00 0.00 O ATOM 198 C5' DT A 7 13.150 -2.254 -7.194 1.00 0.00 C ATOM 199 C4' DT A 7 12.154 -3.355 -7.597 1.00 0.00 C ATOM 200 O4' DT A 7 11.873 -4.283 -6.545 1.00 0.00 O ATOM 201 C3' DT A 7 10.785 -2.856 -8.118 1.00 0.00 C ATOM 202 O3' DT A 7 10.558 -3.328 -9.448 1.00 0.00 O ATOM 203 C2' DT A 7 9.849 -3.556 -7.127 1.00 0.00 C ATOM 204 C1' DT A 7 10.630 -4.849 -6.916 1.00 0.00 C ATOM 205 N1 DT A 7 10.059 -5.868 -5.984 1.00 0.00 N ATOM 206 C2 DT A 7 10.754 -7.086 -5.895 1.00 0.00 C ATOM 207 O2 DT A 7 11.832 -7.318 -6.449 1.00 0.00 O ATOM 208 N3 DT A 7 10.159 -8.099 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9.556 -3.348 -11.747 1.00 0.00 O ATOM 228 OP2 DA A 8 9.497 -1.220 -10.339 1.00 0.00 O ATOM 229 O5' DA A 8 7.993 -3.162 -9.771 1.00 0.00 O ATOM 230 C5' DA A 8 7.560 -4.524 -9.795 1.00 0.00 C ATOM 231 C4' DA A 8 6.256 -4.769 -9.007 1.00 0.00 C ATOM 232 O4' DA A 8 6.488 -4.548 -7.613 1.00 0.00 O ATOM 233 C3' DA A 8 5.132 -3.834 -9.484 1.00 0.00 C ATOM 234 O3' DA A 8 4.001 -4.514 -10.005 1.00 0.00 O ATOM 235 C2' DA A 8 4.712 -3.088 -8.223 1.00 0.00 C ATOM 236 C1' DA A 8 5.451 -3.756 -7.064 1.00 0.00 C ATOM 237 N9 DA A 8 5.989 -2.738 -6.134 1.00 0.00 N ATOM 238 C8 DA A 8 6.719 -1.618 -6.440 1.00 0.00 C ATOM 239 N7 DA A 8 6.903 -0.792 -5.439 1.00 0.00 N ATOM 240 C5 DA A 8 6.190 -1.409 -4.398 1.00 0.00 C ATOM 241 C6 DA A 8 5.870 -1.073 -3.057 1.00 0.00 C ATOM 242 N6 DA A 8 6.232 0.027 -2.427 1.00 0.00 N ATOM 243 N1 DA A 8 5.134 -1.885 -2.304 1.00 0.00 N ATOM 244 C2 DA A 8 4.709 -3.024 -2.833 1.00 0.00 C ATOM 245 N3 DA A 8 4.888 -3.459 -4.076 1.00 0.00 N ATOM 246 C4 DA A 8 5.646 -2.598 -4.811 1.00 0.00 C ATOM 0 H5' DA A 8 8.348 -5.155 -9.383 1.00 0.00 H new ATOM 0 H5'' DA A 8 7.413 -4.832 -10.830 1.00 0.00 H new ATOM 0 H4' DA A 8 5.947 -5.800 -9.179 1.00 0.00 H new ATOM 0 H3' DA A 8 5.493 -3.203 -10.297 1.00 0.00 H new ATOM 0 H2' DA A 8 4.971 -2.031 -8.292 1.00 0.00 H new ATOM 0 H2'' DA A 8 3.633 -3.143 -8.080 1.00 0.00 H new ATOM 0 H1' DA A 8 4.771 -4.384 -6.489 1.00 0.00 H new ATOM 0 H8 DA A 8 7.112 -1.431 -7.429 1.00 0.00 H new ATOM 0 H61 DA A 8 5.950 0.176 -1.458 1.00 0.00 H new ATOM 0 H62 DA A 8 6.794 0.729 -2.908 1.00 0.00 H new ATOM 0 H2 DA A 8 4.151 -3.675 -2.176 1.00 0.00 H new ATOM 258 P DG A 9 3.119 -3.825 -11.178 1.00 0.00 P ATOM 259 OP1 DG A 9 1.892 -4.648 -11.366 1.00 0.00 O ATOM 260 OP2 DG A 9 4.006 -3.601 -12.356 1.00 0.00 O ATOM 261 O5' DG A 9 2.684 -2.394 -10.534 1.00 0.00 O ATOM 262 C5' DG A 9 3.026 -1.138 -11.111 1.00 0.00 C ATOM 263 C4' DG A 9 2.709 0.095 -10.229 1.00 0.00 C ATOM 264 O4' DG A 9 1.529 -0.046 -9.430 1.00 0.00 O ATOM 265 C3' DG A 9 3.827 0.533 -9.258 1.00 0.00 C ATOM 266 O3' DG A 9 4.142 1.885 -9.608 1.00 0.00 O ATOM 267 C2' DG A 9 3.175 0.360 -7.879 1.00 0.00 C ATOM 268 C1' DG A 9 1.731 0.688 -8.229 1.00 0.00 C ATOM 269 N9 DG A 9 0.690 0.429 -7.193 1.00 0.00 N ATOM 270 C8 DG A 9 -0.468 1.161 -7.061 1.00 0.00 C ATOM 271 N7 DG A 9 -1.285 0.742 -6.137 1.00 0.00 N ATOM 272 C5 DG A 9 -0.604 -0.342 -5.590 1.00 0.00 C ATOM 273 C6 DG A 9 -1.011 -1.226 -4.540 1.00 0.00 C ATOM 274 O6 DG A 9 -2.075 -1.242 -3.930 1.00 0.00 O ATOM 275 N1 DG A 9 -0.069 -2.165 -4.212 1.00 0.00 N ATOM 276 C2 DG A 9 1.143 -2.248 -4.801 1.00 0.00 C ATOM 277 N2 DG A 9 1.929 -3.179 -4.327 1.00 0.00 N ATOM 278 N3 DG A 9 1.558 -1.472 -5.808 1.00 0.00 N ATOM 279 C4 DG A 9 0.632 -0.524 -6.178 1.00 0.00 C ATOM 0 H5' DG A 9 2.497 -1.034 -12.058 1.00 0.00 H new ATOM 0 H5'' DG A 9 4.092 -1.138 -11.340 1.00 0.00 H new ATOM 0 H4' DG A 9 2.579 0.856 -10.998 1.00 0.00 H new ATOM 0 H3' DG A 9 4.765 -0.021 -9.283 1.00 0.00 H new ATOM 0 H2' DG A 9 3.290 -0.651 -7.487 1.00 0.00 H new ATOM 0 H2'' DG A 9 3.588 1.040 -7.134 1.00 0.00 H new ATOM 0 H1' DG A 9 1.601 1.766 -8.324 1.00 0.00 H new ATOM 0 H8 DG A 9 -0.684 2.020 -7.679 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.296 -2.840 -3.481 1.00 0.00 H new ATOM 0 H21 DG A 9 2.862 -3.307 -4.718 1.00 0.00 H new ATOM 0 H22 DG A 9 1.609 -3.778 -3.566 1.00 0.00 H new ATOM 291 P DG A 10 5.077 2.875 -8.731 1.00 0.00 P ATOM 292 OP1 DG A 10 5.570 3.951 -9.636 1.00 0.00 O ATOM 293 OP2 DG A 10 6.073 2.074 -7.971 1.00 0.00 O ATOM 294 O5' DG A 10 4.012 3.528 -7.695 1.00 0.00 O ATOM 295 C5' DG A 10 2.916 4.310 -8.168 1.00 0.00 C ATOM 296 C4' DG A 10 1.956 4.766 -7.055 1.00 0.00 C ATOM 297 O4' DG A 10 1.357 3.658 -6.384 1.00 0.00 O ATOM 298 C3' DG A 10 2.664 5.630 -5.999 1.00 0.00 C ATOM 299 O3' DG A 10 2.060 6.921 -5.939 1.00 0.00 O ATOM 300 C2' DG A 10 2.436 4.851 -4.704 1.00 0.00 C ATOM 301 C1' DG A 10 1.193 4.022 -5.024 1.00 0.00 C ATOM 302 N9 DG A 10 1.027 2.828 -4.156 1.00 0.00 N ATOM 303 C8 DG A 10 1.927 1.818 -3.904 1.00 0.00 C ATOM 304 N7 DG A 10 1.490 0.898 -3.083 1.00 0.00 N ATOM 305 C5 DG A 10 0.203 1.337 -2.756 1.00 0.00 C ATOM 306 C6 DG A 10 -0.802 0.759 -1.904 1.00 0.00 C ATOM 307 O6 DG A 10 -0.741 -0.276 -1.245 1.00 0.00 O ATOM 308 N1 DG A 10 -1.975 1.485 -1.856 1.00 0.00 N ATOM 309 C2 DG A 10 -2.152 2.656 -2.515 1.00 0.00 C ATOM 310 N2 DG A 10 -3.302 3.262 -2.376 1.00 0.00 N ATOM 311 N3 DG A 10 -1.245 3.242 -3.295 1.00 0.00 N ATOM 312 C4 DG A 10 -0.084 2.524 -3.395 1.00 0.00 C ATOM 0 H5' DG A 10 2.357 3.730 -8.902 1.00 0.00 H new ATOM 0 H5'' DG A 10 3.304 5.188 -8.684 1.00 0.00 H new ATOM 0 H4' DG A 10 1.188 5.356 -7.556 1.00 0.00 H new ATOM 0 H3' DG A 10 3.720 5.801 -6.206 1.00 0.00 H new ATOM 0 H2' DG A 10 3.290 4.221 -4.455 1.00 0.00 H new ATOM 0 H2'' DG A 10 2.272 5.515 -3.856 1.00 0.00 H new ATOM 0 H1' DG A 10 0.286 4.597 -4.840 1.00 0.00 H new ATOM 0 H8 DG A 10 2.912 1.787 -4.347 1.00 0.00 H new ATOM 0 H1 DG A 10 -2.747 1.122 -1.297 1.00 0.00 H new ATOM 0 H21 DG A 10 -3.474 4.146 -2.856 1.00 0.00 H new ATOM 0 H22 DG A 10 -4.027 2.851 -1.788 1.00 0.00 H new ATOM 324 P DG A 11 2.916 8.281 -5.700 1.00 0.00 P ATOM 325 OP1 DG A 11 2.614 9.217 -6.819 1.00 0.00 O ATOM 326 OP2 DG A 11 4.339 7.941 -5.424 1.00 0.00 O ATOM 327 O5' DG A 11 2.292 8.885 -4.335 1.00 0.00 O ATOM 328 C5' DG A 11 1.035 9.558 -4.314 1.00 0.00 C ATOM 329 C4' DG A 11 0.441 9.693 -2.897 1.00 0.00 C ATOM 330 O4' DG A 11 0.080 8.403 -2.407 1.00 0.00 O ATOM 331 C3' DG A 11 1.413 10.330 -1.881 1.00 0.00 C ATOM 332 O3' DG A 11 0.698 11.189 -0.990 1.00 0.00 O ATOM 333 C2' DG A 11 1.958 9.087 -1.176 1.00 0.00 C ATOM 334 C1' DG A 11 0.707 8.209 -1.150 1.00 0.00 C ATOM 335 N9 DG A 11 0.961 6.767 -0.917 1.00 0.00 N ATOM 336 C8 DG A 11 2.063 6.006 -1.233 1.00 0.00 C ATOM 337 N7 DG A 11 1.951 4.741 -0.922 1.00 0.00 N ATOM 338 C5 DG A 11 0.686 4.666 -0.329 1.00 0.00 C ATOM 339 C6 DG A 11 -0.018 3.557 0.248 1.00 0.00 C ATOM 340 O6 DG A 11 0.349 2.392 0.350 1.00 0.00 O ATOM 341 N1 DG A 11 -1.262 3.884 0.745 1.00 0.00 N ATOM 342 C2 DG A 11 -1.776 5.137 0.707 1.00 0.00 C ATOM 343 N2 DG A 11 -2.969 5.324 1.203 1.00 0.00 N ATOM 344 N3 DG A 11 -1.154 6.199 0.203 1.00 0.00 N ATOM 345 C4 DG A 11 0.079 5.901 -0.310 1.00 0.00 C ATOM 0 H5' DG A 11 0.330 9.018 -4.946 1.00 0.00 H new ATOM 0 H5'' DG A 11 1.155 10.551 -4.747 1.00 0.00 H new ATOM 0 H4' DG A 11 -0.423 10.350 -2.991 1.00 0.00 H new ATOM 0 H3' DG A 11 2.193 10.959 -2.310 1.00 0.00 H new ATOM 0 H2' DG A 11 2.777 8.624 -1.726 1.00 0.00 H new ATOM 0 H2'' DG A 11 2.330 9.308 -0.176 1.00 0.00 H new ATOM 0 H1' DG A 11 0.086 8.505 -0.304 1.00 0.00 H new ATOM 0 H8 DG A 11 2.946 6.419 -1.699 1.00 0.00 H new ATOM 0 H1 DG A 11 -1.825 3.143 1.163 1.00 0.00 H new ATOM 0 H21 DG A 11 -3.386 6.255 1.191 1.00 0.00 H new ATOM 0 H22 DG A 11 -3.484 4.539 1.603 1.00 0.00 H new ATOM 357 P DT A 12 1.432 12.256 -0.011 1.00 0.00 P ATOM 358 OP1 DT A 12 0.382 13.159 0.533 1.00 0.00 O ATOM 359 OP2 DT A 12 2.572 12.869 -0.748 1.00 0.00 O ATOM 360 O5' DT A 12 2.036 11.387 1.216 1.00 0.00 O ATOM 361 C5' DT A 12 1.191 10.620 2.071 1.00 0.00 C ATOM 362 C4' DT A 12 1.958 9.910 3.199 1.00 0.00 C ATOM 363 O4' DT A 12 2.959 9.049 2.664 1.00 0.00 O ATOM 364 C3' DT A 12 2.655 10.902 4.152 1.00 0.00 C ATOM 365 O3' DT A 12 2.452 10.615 5.534 1.00 0.00 O ATOM 366 C2' DT A 12 4.130 10.707 3.820 1.00 0.00 C ATOM 367 C1' DT A 12 4.137 9.231 3.430 1.00 0.00 C ATOM 368 N1 DT A 12 5.346 8.818 2.663 1.00 0.00 N ATOM 369 C2 DT A 12 6.181 7.833 3.212 1.00 0.00 C ATOM 370 O2 DT A 12 5.977 7.279 4.293 1.00 0.00 O ATOM 371 N3 DT A 12 7.299 7.491 2.484 1.00 0.00 N ATOM 372 C4 DT A 12 7.680 8.049 1.281 1.00 0.00 C ATOM 373 O4 DT A 12 8.718 7.651 0.748 1.00 0.00 O ATOM 374 C5 DT A 12 6.780 9.086 0.773 1.00 0.00 C ATOM 375 C7 DT A 12 7.083 9.786 -0.541 1.00 0.00 C ATOM 376 C6 DT A 12 5.663 9.432 1.469 1.00 0.00 C ATOM 0 H5' DT A 12 0.661 9.876 1.476 1.00 0.00 H new ATOM 0 H5'' DT A 12 0.437 11.274 2.508 1.00 0.00 H new ATOM 0 H4' DT A 12 1.213 9.342 3.756 1.00 0.00 H new ATOM 0 H3' DT A 12 2.268 11.911 4.014 1.00 0.00 H new ATOM 0 H2' DT A 12 4.460 11.352 3.006 1.00 0.00 H new ATOM 0 H2'' DT A 12 4.777 10.913 4.672 1.00 0.00 H new ATOM 0 H1' DT A 12 4.164 8.605 4.322 1.00 0.00 H new ATOM 0 H3 DT A 12 7.898 6.761 2.868 1.00 0.00 H new ATOM 0 H71 DT A 12 6.150 10.087 -1.017 1.00 0.00 H new ATOM 0 H72 DT A 12 7.694 10.668 -0.351 1.00 0.00 H new ATOM 0 H73 DT A 12 7.623 9.106 -1.200 1.00 0.00 H new ATOM 0 H6 DT A 12 5.013 10.201 1.080 1.00 0.00 H new ATOM 389 P DT A 13 1.048 10.904 6.293 1.00 0.00 P ATOM 390 OP1 DT A 13 0.468 12.167 5.758 1.00 0.00 O ATOM 391 OP2 DT A 13 1.317 10.814 7.754 1.00 0.00 O ATOM 392 O5' DT A 13 0.097 9.649 5.897 1.00 0.00 O ATOM 393 C5' DT A 13 -1.044 9.787 5.049 1.00 0.00 C ATOM 394 C4' DT A 13 -1.698 8.439 4.695 1.00 0.00 C ATOM 395 O4' DT A 13 -0.850 7.641 3.869 1.00 0.00 O ATOM 396 C3' DT A 13 -2.041 7.610 5.946 1.00 0.00 C ATOM 397 O3' DT A 13 -3.442 7.351 6.018 1.00 0.00 O ATOM 398 C2' DT A 13 -1.251 6.326 5.711 1.00 0.00 C ATOM 399 C1' DT A 13 -1.098 6.279 4.187 1.00 0.00 C ATOM 400 N1 DT A 13 -0.007 5.343 3.773 1.00 0.00 N ATOM 401 C2 DT A 13 -0.191 3.975 4.028 1.00 0.00 C ATOM 402 O2 DT A 13 -1.237 3.490 4.458 1.00 0.00 O ATOM 403 N3 DT A 13 0.877 3.146 3.791 1.00 0.00 N ATOM 404 C4 DT A 13 2.106 3.532 3.313 1.00 0.00 C ATOM 405 O4 DT A 13 3.009 2.700 3.250 1.00 0.00 O ATOM 406 C5 DT A 13 2.198 4.941 2.941 1.00 0.00 C ATOM 407 C7 DT A 13 3.471 5.450 2.289 1.00 0.00 C ATOM 408 C6 DT A 13 1.162 5.792 3.181 1.00 0.00 C ATOM 0 H5' DT A 13 -0.748 10.293 4.130 1.00 0.00 H new ATOM 0 H5'' DT A 13 -1.780 10.424 5.540 1.00 0.00 H new ATOM 0 H4' DT A 13 -2.614 8.694 4.161 1.00 0.00 H new ATOM 0 H3' DT A 13 -1.794 8.106 6.884 1.00 0.00 H new ATOM 0 H2' DT A 13 -0.283 6.352 6.212 1.00 0.00 H new ATOM 0 H2'' DT A 13 -1.782 5.452 6.089 1.00 0.00 H new ATOM 0 H1' DT A 13 -1.965 5.887 3.655 1.00 0.00 H new ATOM 0 H3 DT A 13 0.746 2.154 3.987 1.00 0.00 H new ATOM 0 H71 DT A 13 3.232 6.279 1.623 1.00 0.00 H new ATOM 0 H72 DT A 13 4.163 5.791 3.059 1.00 0.00 H new ATOM 0 H73 DT A 13 3.933 4.646 1.717 1.00 0.00 H new ATOM 0 H6 DT A 13 1.253 6.832 2.906 1.00 0.00 H new ATOM 421 P DA A 14 -4.198 7.095 7.434 1.00 0.00 P ATOM 422 OP1 DA A 14 -5.654 7.305 7.208 1.00 0.00 O ATOM 423 OP2 DA A 14 -3.536 7.914 8.487 1.00 0.00 O ATOM 424 O5' DA A 14 -3.937 5.530 7.780 1.00 0.00 O ATOM 425 C5' DA A 14 -4.625 4.486 7.095 1.00 0.00 C ATOM 426 C4' DA A 14 -4.542 3.109 7.784 1.00 0.00 C ATOM 427 O4' DA A 14 -3.204 2.612 7.747 1.00 0.00 O ATOM 428 C3' DA A 14 -4.976 3.136 9.260 1.00 0.00 C ATOM 429 O3' DA A 14 -5.646 1.933 9.633 1.00 0.00 O ATOM 430 C2' DA A 14 -3.641 3.227 9.988 1.00 0.00 C ATOM 431 C1' DA A 14 -2.743 2.392 9.075 1.00 0.00 C ATOM 432 N9 DA A 14 -1.315 2.763 9.223 1.00 0.00 N ATOM 433 C8 DA A 14 -0.508 3.438 8.336 1.00 0.00 C ATOM 434 N7 DA A 14 0.747 3.527 8.703 1.00 0.00 N ATOM 435 C5 DA A 14 0.754 2.868 9.945 1.00 0.00 C ATOM 436 C6 DA A 14 1.743 2.571 10.919 1.00 0.00 C ATOM 437 N6 DA A 14 3.024 2.883 10.832 1.00 0.00 N ATOM 438 N1 DA A 14 1.437 1.925 12.045 1.00 0.00 N ATOM 439 C2 DA A 14 0.176 1.558 12.230 1.00 0.00 C ATOM 440 N3 DA A 14 -0.856 1.749 11.415 1.00 0.00 N ATOM 441 C4 DA A 14 -0.498 2.416 10.276 1.00 0.00 C ATOM 0 H5' DA A 14 -4.218 4.400 6.087 1.00 0.00 H new ATOM 0 H5'' DA A 14 -5.674 4.765 6.993 1.00 0.00 H new ATOM 0 H4' DA A 14 -5.227 2.468 7.229 1.00 0.00 H new ATOM 0 H3' DA A 14 -5.672 3.945 9.482 1.00 0.00 H new ATOM 0 H2' DA A 14 -3.292 4.256 10.079 1.00 0.00 H new ATOM 0 H2'' DA A 14 -3.695 2.818 10.997 1.00 0.00 H new ATOM 0 H1' DA A 14 -2.800 1.336 9.338 1.00 0.00 H new ATOM 0 H8 DA A 14 -0.878 3.860 7.413 1.00 0.00 H new ATOM 0 H61 DA A 14 3.663 2.628 11.585 1.00 0.00 H new ATOM 0 H62 DA A 14 3.373 3.379 10.012 1.00 0.00 H new ATOM 0 H2 DA A 14 -0.038 1.042 13.154 1.00 0.00 H new ATOM 453 P DG A 15 -7.254 1.865 9.794 1.00 0.00 P ATOM 454 OP1 DG A 15 -7.673 2.911 10.769 1.00 0.00 O ATOM 455 OP2 DG A 15 -7.607 0.449 10.089 1.00 0.00 O ATOM 456 O5' DG A 15 -7.848 2.221 8.323 1.00 0.00 O ATOM 457 C5' DG A 15 -8.344 3.521 8.014 1.00 0.00 C ATOM 458 C4' DG A 15 -8.728 3.728 6.537 1.00 0.00 C ATOM 459 O4' DG A 15 -7.577 3.852 5.709 1.00 0.00 O ATOM 460 C3' DG A 15 -9.629 2.626 5.935 1.00 0.00 C ATOM 461 O3' DG A 15 -10.850 3.232 5.500 1.00 0.00 O ATOM 462 C2' DG A 15 -8.741 2.074 4.808 1.00 0.00 C ATOM 463 C1' DG A 15 -7.908 3.302 4.452 1.00 0.00 C ATOM 464 N9 DG A 15 -6.691 3.069 3.631 1.00 0.00 N ATOM 465 C8 DG A 15 -6.309 3.788 2.524 1.00 0.00 C ATOM 466 N7 DG A 15 -5.128 3.479 2.054 1.00 0.00 N ATOM 467 C5 DG A 15 -4.693 2.464 2.911 1.00 0.00 C ATOM 468 C6 DG A 15 -3.474 1.698 2.918 1.00 0.00 C ATOM 469 O6 DG A 15 -2.502 1.797 2.170 1.00 0.00 O ATOM 470 N1 DG A 15 -3.430 0.736 3.901 1.00 0.00 N ATOM 471 C2 DG A 15 -4.414 0.551 4.809 1.00 0.00 C ATOM 472 N2 DG A 15 -4.251 -0.387 5.704 1.00 0.00 N ATOM 473 N3 DG A 15 -5.542 1.252 4.862 1.00 0.00 N ATOM 474 C4 DG A 15 -5.642 2.196 3.876 1.00 0.00 C ATOM 0 H5' DG A 15 -7.588 4.258 8.286 1.00 0.00 H new ATOM 0 H5'' DG A 15 -9.219 3.718 8.634 1.00 0.00 H new ATOM 0 H4' DG A 15 -9.306 4.652 6.552 1.00 0.00 H new ATOM 0 H3' DG A 15 -9.946 1.825 6.603 1.00 0.00 H new ATOM 0 H2' DG A 15 -8.123 1.241 5.143 1.00 0.00 H new ATOM 0 H2'' DG A 15 -9.327 1.716 3.962 1.00 0.00 H new ATOM 0 H1' DG A 15 -8.487 3.955 3.799 1.00 0.00 H new ATOM 0 H8 DG A 15 -6.934 4.547 2.078 1.00 0.00 H new ATOM 0 H1 DG A 15 -2.611 0.130 3.947 1.00 0.00 H new ATOM 0 H21 DG A 15 -4.973 -0.554 6.405 1.00 0.00 H new ATOM 0 H22 DG A 15 -3.402 -0.952 5.702 1.00 0.00 H new ATOM 486 P DG A 16 -11.979 2.468 4.619 1.00 0.00 P ATOM 487 OP1 DG A 16 -13.267 3.186 4.827 1.00 0.00 O ATOM 488 OP2 DG A 16 -11.928 1.011 4.920 1.00 0.00 O ATOM 489 O5' DG A 16 -11.501 2.708 3.087 1.00 0.00 O ATOM 490 C5' DG A 16 -11.497 4.015 2.518 1.00 0.00 C ATOM 491 C4' DG A 16 -11.036 4.067 1.051 1.00 0.00 C ATOM 492 O4' DG A 16 -9.636 3.824 0.910 1.00 0.00 O ATOM 493 C3' DG A 16 -11.782 3.085 0.121 1.00 0.00 C ATOM 494 O3' DG A 16 -12.445 3.835 -0.901 1.00 0.00 O ATOM 495 C2' DG A 16 -10.636 2.214 -0.410 1.00 0.00 C ATOM 496 C1' DG A 16 -9.483 3.208 -0.355 1.00 0.00 C ATOM 497 N9 DG A 16 -8.127 2.644 -0.586 1.00 0.00 N ATOM 498 C8 DG A 16 -7.220 3.098 -1.514 1.00 0.00 C ATOM 499 N7 DG A 16 -6.052 2.518 -1.465 1.00 0.00 N ATOM 500 C5 DG A 16 -6.195 1.601 -0.420 1.00 0.00 C ATOM 501 C6 DG A 16 -5.246 0.678 0.136 1.00 0.00 C ATOM 502 O6 DG A 16 -4.070 0.516 -0.184 1.00 0.00 O ATOM 503 N1 DG A 16 -5.757 -0.100 1.151 1.00 0.00 N ATOM 504 C2 DG A 16 -7.023 0.020 1.622 1.00 0.00 C ATOM 505 N2 DG A 16 -7.375 -0.768 2.608 1.00 0.00 N ATOM 506 N3 DG A 16 -7.928 0.884 1.159 1.00 0.00 N ATOM 507 C4 DG A 16 -7.463 1.652 0.121 1.00 0.00 C ATOM 0 H5' DG A 16 -10.847 4.656 3.114 1.00 0.00 H new ATOM 0 H5'' DG A 16 -12.502 4.431 2.585 1.00 0.00 H new ATOM 0 H4' DG A 16 -11.276 5.085 0.745 1.00 0.00 H new ATOM 0 H3' DG A 16 -12.562 2.483 0.587 1.00 0.00 H new ATOM 0 H2' DG A 16 -10.458 1.338 0.214 1.00 0.00 H new ATOM 0 H2'' DG A 16 -10.824 1.853 -1.421 1.00 0.00 H new ATOM 0 H1' DG A 16 -9.539 3.913 -1.185 1.00 0.00 H new ATOM 0 H8 DG A 16 -7.456 3.874 -2.228 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.151 -0.804 1.571 1.00 0.00 H new ATOM 0 H21 DG A 16 -8.318 -0.712 2.994 1.00 0.00 H new ATOM 0 H22 DG A 16 -6.706 -1.437 2.990 1.00 0.00 H new ATOM 519 P DG A 17 -13.376 3.161 -2.048 1.00 0.00 P ATOM 520 OP1 DG A 17 -14.329 4.205 -2.519 1.00 0.00 O ATOM 521 OP2 DG A 17 -13.934 1.881 -1.532 1.00 0.00 O ATOM 522 O5' DG A 17 -12.350 2.828 -3.256 1.00 0.00 O ATOM 523 C5' DG A 17 -11.715 3.871 -3.992 1.00 0.00 C ATOM 524 C4' DG A 17 -10.578 3.383 -4.907 1.00 0.00 C ATOM 525 O4' DG A 17 -9.532 2.790 -4.133 1.00 0.00 O ATOM 526 C3' DG A 17 -11.026 2.333 -5.944 1.00 0.00 C ATOM 527 O3' DG A 17 -10.408 2.581 -7.203 1.00 0.00 O ATOM 528 C2' DG A 17 -10.474 1.035 -5.368 1.00 0.00 C ATOM 529 C1' DG A 17 -9.180 1.568 -4.763 1.00 0.00 C ATOM 530 N9 DG A 17 -8.525 0.637 -3.820 1.00 0.00 N ATOM 531 C8 DG A 17 -9.075 -0.136 -2.826 1.00 0.00 C ATOM 532 N7 DG A 17 -8.211 -0.884 -2.187 1.00 0.00 N ATOM 533 C5 DG A 17 -6.995 -0.584 -2.814 1.00 0.00 C ATOM 534 C6 DG A 17 -5.658 -1.065 -2.578 1.00 0.00 C ATOM 535 O6 DG A 17 -5.278 -1.872 -1.730 1.00 0.00 O ATOM 536 N1 DG A 17 -4.719 -0.521 -3.435 1.00 0.00 N ATOM 537 C2 DG A 17 -5.020 0.365 -4.413 1.00 0.00 C ATOM 538 N2 DG A 17 -4.048 0.786 -5.179 1.00 0.00 N ATOM 539 N3 DG A 17 -6.234 0.842 -4.664 1.00 0.00 N ATOM 540 C4 DG A 17 -7.184 0.332 -3.824 1.00 0.00 C ATOM 0 H5' DG A 17 -11.316 4.605 -3.292 1.00 0.00 H new ATOM 0 H5'' DG A 17 -12.463 4.382 -4.598 1.00 0.00 H new ATOM 0 H4' DG A 17 -10.238 4.273 -5.437 1.00 0.00 H new ATOM 0 H3' DG A 17 -12.103 2.330 -6.109 1.00 0.00 H new ATOM 0 H2' DG A 17 -11.135 0.591 -4.623 1.00 0.00 H new ATOM 0 H2'' DG A 17 -10.300 0.277 -6.132 1.00 0.00 H new ATOM 0 H1' DG A 17 -8.433 1.703 -5.546 1.00 0.00 H new ATOM 0 H8 DG A 17 -10.129 -0.127 -2.592 1.00 0.00 H new ATOM 0 H1 DG A 17 -3.745 -0.803 -3.324 1.00 0.00 H new ATOM 0 H21 DG A 17 -4.240 1.454 -5.926 1.00 0.00 H new ATOM 0 H22 DG A 17 -3.098 0.447 -5.030 1.00 0.00 H new ATOM 552 P DT A 18 -11.137 3.405 -8.387 1.00 0.00 P ATOM 553 OP1 DT A 18 -10.093 4.191 -9.098 1.00 0.00 O ATOM 554 OP2 DT A 18 -12.334 4.116 -7.859 1.00 0.00 O ATOM 555 O5' DT A 18 -11.590 2.197 -9.359 1.00 0.00 O ATOM 556 C5' DT A 18 -12.888 1.612 -9.331 1.00 0.00 C ATOM 557 C4' DT A 18 -12.880 0.122 -9.733 1.00 0.00 C ATOM 558 O4' DT A 18 -12.010 -0.094 -10.846 1.00 0.00 O ATOM 559 C3' DT A 18 -12.432 -0.792 -8.577 1.00 0.00 C ATOM 560 O3' DT A 18 -13.358 -1.863 -8.395 1.00 0.00 O ATOM 561 C2' DT A 18 -11.057 -1.295 -9.002 1.00 0.00 C ATOM 562 C1' DT A 18 -11.037 -1.076 -10.521 1.00 0.00 C ATOM 563 N1 DT A 18 -9.689 -0.682 -11.032 1.00 0.00 N ATOM 564 C2 DT A 18 -9.117 -1.445 -12.062 1.00 0.00 C ATOM 565 O2 DT A 18 -9.691 -2.375 -12.632 1.00 0.00 O ATOM 566 N3 DT A 18 -7.829 -1.125 -12.435 1.00 0.00 N ATOM 567 C4 DT A 18 -7.050 -0.134 -11.876 1.00 0.00 C ATOM 568 O4 DT A 18 -5.903 0.025 -12.300 1.00 0.00 O ATOM 569 C5 DT A 18 -7.704 0.636 -10.818 1.00 0.00 C ATOM 570 C7 DT A 18 -6.967 1.763 -10.112 1.00 0.00 C ATOM 571 C6 DT A 18 -8.980 0.353 -10.448 1.00 0.00 C ATOM 0 H5' DT A 18 -13.544 2.162 -10.005 1.00 0.00 H new ATOM 0 H5'' DT A 18 -13.305 1.711 -8.329 1.00 0.00 H new ATOM 0 H4' DT A 18 -13.906 -0.131 -9.999 1.00 0.00 H new ATOM 0 H3' DT A 18 -12.392 -0.275 -7.618 1.00 0.00 H new ATOM 0 H2' DT A 18 -10.259 -0.741 -8.508 1.00 0.00 H new ATOM 0 H2'' DT A 18 -10.920 -2.346 -8.748 1.00 0.00 H new ATOM 0 H1' DT A 18 -11.274 -2.022 -11.009 1.00 0.00 H new ATOM 0 H3 DT A 18 -7.415 -1.670 -13.192 1.00 0.00 H new ATOM 0 H71 DT A 18 -7.682 2.520 -9.790 1.00 0.00 H new ATOM 0 H72 DT A 18 -6.442 1.366 -9.243 1.00 0.00 H new ATOM 0 H73 DT A 18 -6.247 2.212 -10.796 1.00 0.00 H new ATOM 0 H6 DT A 18 -9.452 0.949 -9.681 1.00 0.00 H new ATOM 584 P DT A 19 -13.430 -2.723 -7.018 1.00 0.00 P ATOM 585 OP1 DT A 19 -14.858 -3.100 -6.820 1.00 0.00 O ATOM 586 OP2 DT A 19 -12.747 -1.968 -5.933 1.00 0.00 O ATOM 587 O5' DT A 19 -12.559 -4.066 -7.311 1.00 0.00 O ATOM 588 C5' DT A 19 -13.150 -5.248 -7.850 1.00 0.00 C ATOM 589 C4' DT A 19 -12.275 -6.507 -7.704 1.00 0.00 C ATOM 590 O4' DT A 19 -11.180 -6.494 -8.617 1.00 0.00 O ATOM 591 C3' DT A 19 -11.690 -6.683 -6.289 1.00 0.00 C ATOM 592 O3' DT A 19 -11.947 -7.976 -5.745 1.00 0.00 O ATOM 593 C2' DT A 19 -10.192 -6.522 -6.509 1.00 0.00 C ATOM 594 C1' DT A 19 -10.062 -7.042 -7.936 1.00 0.00 C ATOM 595 N1 DT A 19 -8.785 -6.679 -8.611 1.00 0.00 N ATOM 596 C2 DT A 19 -7.927 -7.710 -9.018 1.00 0.00 C ATOM 597 O2 DT A 19 -8.161 -8.910 -8.852 1.00 0.00 O ATOM 598 N3 DT A 19 -6.762 -7.337 -9.652 1.00 0.00 N ATOM 599 C4 DT A 19 -6.372 -6.042 -9.921 1.00 0.00 C ATOM 600 O4 DT A 19 -5.307 -5.859 -10.513 1.00 0.00 O ATOM 601 C5 DT A 19 -7.304 -5.011 -9.460 1.00 0.00 C ATOM 602 C7 DT A 19 -6.999 -3.542 -9.705 1.00 0.00 C ATOM 603 C6 DT A 19 -8.451 -5.356 -8.818 1.00 0.00 C ATOM 0 H5' DT A 19 -13.363 -5.086 -8.907 1.00 0.00 H new ATOM 0 H5'' DT A 19 -14.106 -5.422 -7.355 1.00 0.00 H new ATOM 0 H4' DT A 19 -12.950 -7.336 -7.917 1.00 0.00 H new ATOM 0 H3' DT A 19 -12.128 -5.974 -5.586 1.00 0.00 H new ATOM 0 H2' DT A 19 -9.868 -5.485 -6.415 1.00 0.00 H new ATOM 0 H2'' DT A 19 -9.604 -7.105 -5.800 1.00 0.00 H new ATOM 0 H1' DT A 19 -10.044 -8.132 -7.939 1.00 0.00 H new ATOM 0 H3 DT A 19 -6.133 -8.084 -9.948 1.00 0.00 H new ATOM 0 H71 DT A 19 -5.919 -3.392 -9.722 1.00 0.00 H new ATOM 0 H72 DT A 19 -7.422 -3.237 -10.662 1.00 0.00 H new ATOM 0 H73 DT A 19 -7.436 -2.942 -8.907 1.00 0.00 H new ATOM 0 H6 DT A 19 -9.114 -4.580 -8.463 1.00 0.00 H new ATOM 616 P DA A 20 -13.038 -8.164 -4.569 1.00 0.00 P ATOM 617 OP1 DA A 20 -12.986 -9.576 -4.101 1.00 0.00 O ATOM 618 OP2 DA A 20 -14.338 -7.622 -5.051 1.00 0.00 O ATOM 619 O5' DA A 20 -12.471 -7.189 -3.406 1.00 0.00 O ATOM 620 C5' DA A 20 -11.385 -7.563 -2.559 1.00 0.00 C ATOM 621 C4' DA A 20 -10.541 -6.363 -2.082 1.00 0.00 C ATOM 622 O4' DA A 20 -9.624 -5.940 -3.094 1.00 0.00 O ATOM 623 C3' DA A 20 -11.370 -5.124 -1.667 1.00 0.00 C ATOM 624 O3' DA A 20 -10.938 -4.606 -0.414 1.00 0.00 O ATOM 625 C2' DA A 20 -10.973 -4.113 -2.738 1.00 0.00 C ATOM 626 C1' DA A 20 -9.522 -4.537 -2.946 1.00 0.00 C ATOM 627 N9 DA A 20 -8.849 -3.867 -4.078 1.00 0.00 N ATOM 628 C8 DA A 20 -9.392 -3.145 -5.117 1.00 0.00 C ATOM 629 N7 DA A 20 -8.507 -2.639 -5.940 1.00 0.00 N ATOM 630 C5 DA A 20 -7.287 -3.062 -5.384 1.00 0.00 C ATOM 631 C6 DA A 20 -5.919 -2.904 -5.720 1.00 0.00 C ATOM 632 N6 DA A 20 -5.474 -2.224 -6.758 1.00 0.00 N ATOM 633 N1 DA A 20 -4.947 -3.437 -4.976 1.00 0.00 N ATOM 634 C2 DA A 20 -5.302 -4.092 -3.880 1.00 0.00 C ATOM 635 N3 DA A 20 -6.528 -4.308 -3.417 1.00 0.00 N ATOM 636 C4 DA A 20 -7.486 -3.782 -4.237 1.00 0.00 C ATOM 0 H5' DA A 20 -10.741 -8.262 -3.093 1.00 0.00 H new ATOM 0 H5'' DA A 20 -11.777 -8.091 -1.690 1.00 0.00 H new ATOM 0 H4' DA A 20 -10.021 -6.738 -1.200 1.00 0.00 H new ATOM 0 H3' DA A 20 -12.434 -5.343 -1.580 1.00 0.00 H new ATOM 0 H2' DA A 20 -11.572 -4.204 -3.644 1.00 0.00 H new ATOM 0 H2'' DA A 20 -11.065 -3.082 -2.397 1.00 0.00 H new ATOM 0 H1' DA A 20 -8.880 -4.242 -2.116 1.00 0.00 H new ATOM 0 H8 DA A 20 -10.456 -3.008 -5.243 1.00 0.00 H new ATOM 0 H61 DA A 20 -4.471 -2.157 -6.932 1.00 0.00 H new ATOM 0 H62 DA A 20 -6.133 -1.765 -7.387 1.00 0.00 H new ATOM 0 H2 DA A 20 -4.495 -4.501 -3.290 1.00 0.00 H new HETATM 648 P 8OG A 21 -11.917 -3.854 0.638 1.00 0.00 P HETATM 649 OP1 8OG A 21 -13.333 -3.900 0.166 1.00 0.00 O HETATM 650 OP2 8OG A 21 -11.303 -2.532 0.940 1.00 0.00 O HETATM 651 O5' 8OG A 21 -11.787 -4.783 1.959 1.00 0.00 O HETATM 652 C5' 8OG A 21 -12.229 -6.136 1.980 1.00 0.00 C HETATM 653 C4' 8OG A 21 -11.402 -7.009 2.948 1.00 0.00 C HETATM 654 O4' 8OG A 21 -10.129 -7.297 2.364 1.00 0.00 O HETATM 655 C3' 8OG A 21 -11.155 -6.374 4.333 1.00 0.00 C HETATM 656 O3' 8OG A 21 -11.303 -7.373 5.346 1.00 0.00 O HETATM 657 C2' 8OG A 21 -9.718 -5.868 4.177 1.00 0.00 C HETATM 658 C1' 8OG A 21 -9.118 -6.968 3.306 1.00 0.00 C HETATM 659 N9 8OG A 21 -7.821 -6.628 2.663 1.00 0.00 N HETATM 660 C8 8OG A 21 -6.681 -7.393 2.647 1.00 0.00 C HETATM 661 N7 8OG A 21 -5.685 -6.900 1.991 1.00 0.00 N HETATM 662 C5 8OG A 21 -6.206 -5.739 1.418 1.00 0.00 C HETATM 663 C6 8OG A 21 -5.621 -4.790 0.512 1.00 0.00 C HETATM 664 O6 8OG A 21 -4.481 -4.785 0.058 1.00 0.00 O HETATM 665 N1 8OG A 21 -6.481 -3.782 0.133 1.00 0.00 N HETATM 666 C2 8OG A 21 -7.765 -3.692 0.582 1.00 0.00 C HETATM 667 N2 8OG A 21 -8.523 -2.730 0.125 1.00 0.00 N HETATM 668 N3 8OG A 21 -8.325 -4.533 1.448 1.00 0.00 N HETATM 669 C4 8OG A 21 -7.512 -5.556 1.831 1.00 0.00 C HETATM 670 O8 8OG A 21 -6.578 -8.495 3.186 1.00 0.00 O HETATM 0 H5'' 8OG A 21 -13.279 -6.168 2.272 1.00 0.00 H new HETATM 0 H2'' 8OG A 21 -9.674 -4.891 3.696 1.00 0.00 H new HETATM 0 H7 8OG A 21 -4.739 -7.272 1.910 1.00 0.00 H new HETATM 0 H5' 8OG A 21 -12.165 -6.552 0.975 1.00 0.00 H new HETATM 0 H4' 8OG A 21 -11.998 -7.907 3.108 1.00 0.00 H new HETATM 0 H3' 8OG A 21 -11.842 -5.581 4.629 1.00 0.00 H new HETATM 0 H22 8OG A 21 -9.487 -2.644 0.447 1.00 0.00 H new HETATM 0 H21 8OG A 21 -8.150 -2.066 -0.554 1.00 0.00 H new HETATM 0 H2' 8OG A 21 -9.207 -5.775 5.135 1.00 0.00 H new HETATM 0 H1' 8OG A 21 -8.842 -7.819 3.928 1.00 0.00 H new HETATM 0 H1 8OG A 21 -6.141 -3.070 -0.514 1.00 0.00 H new ATOM 682 P DG A 22 -11.231 -7.048 6.935 1.00 0.00 P ATOM 683 OP1 DG A 22 -11.800 -8.217 7.660 1.00 0.00 O ATOM 684 OP2 DG A 22 -11.832 -5.708 7.178 1.00 0.00 O ATOM 685 O5' DG A 22 -9.649 -6.965 7.270 1.00 0.00 O ATOM 686 C5' DG A 22 -8.809 -8.110 7.148 1.00 0.00 C ATOM 687 C4' DG A 22 -7.307 -7.774 7.131 1.00 0.00 C ATOM 688 O4' DG A 22 -6.965 -7.021 5.969 1.00 0.00 O ATOM 689 C3' DG A 22 -6.839 -6.979 8.367 1.00 0.00 C ATOM 690 O3' DG A 22 -5.842 -7.731 9.060 1.00 0.00 O ATOM 691 C2' DG A 22 -6.305 -5.682 7.746 1.00 0.00 C ATOM 692 C1' DG A 22 -5.934 -6.127 6.334 1.00 0.00 C ATOM 693 N9 DG A 22 -5.820 -5.009 5.367 1.00 0.00 N ATOM 694 C8 DG A 22 -6.713 -3.994 5.108 1.00 0.00 C ATOM 695 N7 DG A 22 -6.300 -3.117 4.228 1.00 0.00 N ATOM 696 C5 DG A 22 -5.016 -3.573 3.908 1.00 0.00 C ATOM 697 C6 DG A 22 -4.021 -3.034 3.025 1.00 0.00 C ATOM 698 O6 DG A 22 -4.092 -2.033 2.316 1.00 0.00 O ATOM 699 N1 DG A 22 -2.851 -3.758 3.003 1.00 0.00 N ATOM 700 C2 DG A 22 -2.630 -4.857 3.760 1.00 0.00 C ATOM 701 N2 DG A 22 -1.436 -5.393 3.720 1.00 0.00 N ATOM 702 N3 DG A 22 -3.534 -5.424 4.558 1.00 0.00 N ATOM 703 C4 DG A 22 -4.712 -4.725 4.600 1.00 0.00 C ATOM 0 H5' DG A 22 -9.064 -8.641 6.231 1.00 0.00 H new ATOM 0 H5'' DG A 22 -9.012 -8.789 7.977 1.00 0.00 H new ATOM 0 H4' DG A 22 -6.801 -8.739 7.134 1.00 0.00 H new ATOM 0 H3' DG A 22 -7.607 -6.776 9.113 1.00 0.00 H new ATOM 0 H2' DG A 22 -7.058 -4.894 7.739 1.00 0.00 H new ATOM 0 H2'' DG A 22 -5.443 -5.295 8.290 1.00 0.00 H new ATOM 0 H1' DG A 22 -4.944 -6.583 6.318 1.00 0.00 H new ATOM 0 H8 DG A 22 -7.676 -3.927 5.592 1.00 0.00 H new ATOM 0 H1 DG A 22 -2.106 -3.448 2.379 1.00 0.00 H new ATOM 0 H21 DG A 22 -1.230 -6.223 4.277 1.00 0.00 H new ATOM 0 H22 DG A 22 -0.712 -4.981 3.132 1.00 0.00 H new ATOM 715 P DG A 23 -5.131 -7.224 10.426 1.00 0.00 P ATOM 716 OP1 DG A 23 -4.959 -8.408 11.313 1.00 0.00 O ATOM 717 OP2 DG A 23 -5.861 -6.043 10.961 1.00 0.00 O ATOM 718 O5' DG A 23 -3.670 -6.738 9.919 1.00 0.00 O ATOM 719 C5' DG A 23 -2.679 -7.681 9.514 1.00 0.00 C ATOM 720 C4' DG A 23 -1.302 -7.054 9.236 1.00 0.00 C ATOM 721 O4' DG A 23 -1.326 -6.278 8.042 1.00 0.00 O ATOM 722 C3' DG A 23 -0.802 -6.161 10.389 1.00 0.00 C ATOM 723 O3' DG A 23 0.484 -6.603 10.819 1.00 0.00 O ATOM 724 C2' DG A 23 -0.785 -4.770 9.747 1.00 0.00 C ATOM 725 C1' DG A 23 -0.584 -5.095 8.269 1.00 0.00 C ATOM 726 N9 DG A 23 -1.055 -4.035 7.348 1.00 0.00 N ATOM 727 C8 DG A 23 -2.327 -3.531 7.200 1.00 0.00 C ATOM 728 N7 DG A 23 -2.448 -2.652 6.239 1.00 0.00 N ATOM 729 C5 DG A 23 -1.155 -2.566 5.714 1.00 0.00 C ATOM 730 C6 DG A 23 -0.629 -1.799 4.618 1.00 0.00 C ATOM 731 O6 DG A 23 -1.227 -1.034 3.866 1.00 0.00 O ATOM 732 N1 DG A 23 0.725 -1.959 4.423 1.00 0.00 N ATOM 733 C2 DG A 23 1.502 -2.756 5.198 1.00 0.00 C ATOM 734 N2 DG A 23 2.789 -2.772 4.960 1.00 0.00 N ATOM 735 N3 DG A 23 1.058 -3.513 6.199 1.00 0.00 N ATOM 736 C4 DG A 23 -0.288 -3.379 6.410 1.00 0.00 C ATOM 0 H5' DG A 23 -3.023 -8.192 8.615 1.00 0.00 H new ATOM 0 H5'' DG A 23 -2.573 -8.439 10.291 1.00 0.00 H new ATOM 0 H4' DG A 23 -0.614 -7.893 9.130 1.00 0.00 H new ATOM 0 H3' DG A 23 -1.415 -6.181 11.290 1.00 0.00 H new ATOM 0 H2' DG A 23 -1.716 -4.230 9.922 1.00 0.00 H new ATOM 0 H2'' DG A 23 0.021 -4.151 10.140 1.00 0.00 H new ATOM 0 H1' DG A 23 0.482 -5.196 8.066 1.00 0.00 H new ATOM 0 H8 DG A 23 -3.154 -3.835 7.824 1.00 0.00 H new ATOM 0 H1 DG A 23 1.166 -1.452 3.656 1.00 0.00 H new ATOM 0 H21 DG A 23 3.404 -3.359 5.523 1.00 0.00 H new ATOM 0 H22 DG A 23 3.176 -2.197 4.212 1.00 0.00 H new ATOM 748 P DA A 24 1.169 -6.097 12.200 1.00 0.00 P ATOM 749 OP1 DA A 24 2.136 -7.141 12.637 1.00 0.00 O ATOM 750 OP2 DA A 24 0.102 -5.682 13.151 1.00 0.00 O ATOM 751 O5' DA A 24 2.000 -4.778 11.769 1.00 0.00 O ATOM 752 C5' DA A 24 3.213 -4.874 11.028 1.00 0.00 C ATOM 753 C4' DA A 24 3.734 -3.507 10.552 1.00 0.00 C ATOM 754 O4' DA A 24 2.876 -2.977 9.543 1.00 0.00 O ATOM 755 C3' DA A 24 3.817 -2.463 11.689 1.00 0.00 C ATOM 756 O3' DA A 24 5.045 -1.729 11.664 1.00 0.00 O ATOM 757 C2' DA A 24 2.662 -1.525 11.352 1.00 0.00 C ATOM 758 C1' DA A 24 2.676 -1.608 9.828 1.00 0.00 C ATOM 759 N9 DA A 24 1.458 -1.098 9.155 1.00 0.00 N ATOM 760 C8 DA A 24 0.138 -1.180 9.539 1.00 0.00 C ATOM 761 N7 DA A 24 -0.698 -0.589 8.723 1.00 0.00 N ATOM 762 C5 DA A 24 0.149 -0.059 7.737 1.00 0.00 C ATOM 763 C6 DA A 24 -0.034 0.729 6.574 1.00 0.00 C ATOM 764 N6 DA A 24 -1.191 1.180 6.135 1.00 0.00 N ATOM 765 N1 DA A 24 1.000 1.103 5.823 1.00 0.00 N ATOM 766 C2 DA A 24 2.216 0.747 6.208 1.00 0.00 C ATOM 767 N3 DA A 24 2.552 0.025 7.272 1.00 0.00 N ATOM 768 C4 DA A 24 1.460 -0.358 7.997 1.00 0.00 C ATOM 0 H5' DA A 24 3.054 -5.518 10.163 1.00 0.00 H new ATOM 0 H5'' DA A 24 3.973 -5.352 11.646 1.00 0.00 H new ATOM 0 H4' DA A 24 4.739 -3.686 10.169 1.00 0.00 H new ATOM 0 H3' DA A 24 3.769 -2.922 12.677 1.00 0.00 H new ATOM 0 H2' DA A 24 1.716 -1.861 11.777 1.00 0.00 H new ATOM 0 H2'' DA A 24 2.832 -0.511 11.714 1.00 0.00 H new ATOM 0 HO3' DA A 24 5.053 -1.080 12.398 1.00 0.00 H new ATOM 0 H1' DA A 24 3.460 -0.959 9.438 1.00 0.00 H new ATOM 0 H8 DA A 24 -0.180 -1.689 10.437 1.00 0.00 H new ATOM 0 H61 DA A 24 -1.230 1.743 5.285 1.00 0.00 H new ATOM 0 H62 DA A 24 -2.048 0.967 6.645 1.00 0.00 H new ATOM 0 H2 DA A 24 3.031 1.083 5.584 1.00 0.00 H new TER 781 DA A 24